Tert-Butyl Formate

Tert-Butyl Formate

SCHEMBL28258283

CC(C)(C)OC=O.FC(F)Oc1cc(Br)ccc1N1CCNCC1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 13/20 0.38
USP28 Q96RU2 2/20 0.38
USP25 Q9UHP3 2/20 0.38
HTR7 P34969 1/20 0.37
HTR4 Q13639 1/20 0.37
NCF1 P14598 1/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
ADRB1 P08588 1/20 0.36
DRD2 P14416 1/20 0.36
CYP2C19 P33261 1/20 0.36
DRD3 P35462 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
RBP4 P02753 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19212119 0.87 NCF1 (0.45) HTR6HTR7HTR4NCF1HTR3E
Tert-Butyl Formate SCHEMBL28840344 0.86 HTR6 (0.48) HTR6HTR7HTR4HTR3EHTR3B
Tert-Butyl Formate SCHEMBL28255190 0.77 HTR6 (0.36) HTR6HTR3EHTR3BHTR3AHTR3D
SCHEMBL28258169 0.76 SLC6A4 (0.38) HTR6DRD2RBP4
Tert-Butyl Formate SCHEMBL27944991 0.76 MAPT (0.39) HTR6USP28USP25ADRB1MAPT
Tert-Butyl Formate SCHEMBL27621449 0.75 KDR (0.41) HTR6HTR7HTR3EHTR3BADRB1
SCHEMBL29707350 0.75 BACE1 (0.50) LMNAMAPTRBP4
SCHEMBL19212185 0.75 BACE1 (0.50) LMNAMAPTRBP4
Tert-Butyl Formate SCHEMBL27859337 0.74 ADRB1 (0.47) HTR6HTR3EHTR3BADRB1HTR3A
Tert-Butyl Formate SCHEMBL28112679 0.74 HTR6 (0.44) HTR6HTR7HTR3EHTR3BADRB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109071560-A Thienopyridine formamide as ubiquitin-specific protease inhibitor 福马治疗股份有限公司 2018-12-21 CN disclosed